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  1. Third-Parties
  2. MatprojStructure
  3. mp-1195612

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1195612
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 64
  • Number of elements: 3
  • Element list: ['La', 'Mn', 'C']
  • Chemical System: C-La-Mn
  • Density: 5.920965941258501
  • Atomic Density: 0.059771622445382255
  • Unit Cell Volume: 1070.7422248489495
  • Molar Volume: 10.075250618306162
  • Full Formula: La22 Mn6 C36
  • Reduced Formula: La11(MnC6)3
  • Formula Anonymous: A3B11C18
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -513.35648322
  • Final energy per atom: -8.0211950503125
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.